CHEBI:209739 - 3beta-hydroxy-6-O-acetylpereniporin A

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name 3beta-hydroxy-6-O-acetylpereniporin A
ChEBI ID CHEBI:209739
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C17H26O6
Net Charge 0
Average Mass 326.389
Monoisotopic Mass 326.17294
InChI InChI=1S/C17H26O6/c1-9(18)23-11-7-10-8-22-14(20)17(10,21)16(4)6-5-12(19)15(2,3)13(11)16/h7,11-14,19-21H,5-6,8H2,1-4H3/t11-,12+,13+,14-,16+,17+/m1/s1
InChIKey CUPLMGKGSLIRNY-FKKJATDVSA-N
SMILES O=C(O[C@@H]1C=C2[C@](O)([C@H](O)OC2)[C@@]3([C@@H]1C([C@@H](O)CC3)(C)C)C)C
Metabolite of Species Details
Perenniporia maackiae (NCBI:txid933052) See: PubMed
ChEBI Ontology
Outgoing 3beta-hydroxy-6-O-acetylpereniporin A (CHEBI:209739) is a naphthofuran (CHEBI:39270)
IUPAC Name
[(1R,5R,5aS,7S,9aS,9bS)-1,7,9b-trihydroxy-6,6,9a-trimethyl-3,5,5a,7,8,9-hexahydro-1H-benzo[e][2]benzouran-5-yl] acetate
Manual Xref Database
78439087 ChemSpider
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